(4-chloranyl-5,6-dimethyl-1-oxidanidyl-pyridin-1-ium-3-yl)methyl ethanoate

Systemtic Name: (4-chloranyl-5,6-dimethyl-1-oxidanidyl-pyridin-1-ium-3-yl)methyl ethanoate Openeye Name: (4-chloro-5,6-dimethyl-1-oxido-pyridin-1-ium-3-yl)methyl acetate CAS Name: acetic acid (4-chloro-5,6-dimethyl-1-oxido-3-pyridin-1-iumyl)methyl ester IUPAC Name: (4-chloro-5,6-dimethyl-1-oxidopyridin-1-ium-3-yl)methyl acetate Traditional Name: acetic acid (4-chloro-5,6-dimethyl-1-oxido-pyridin-1-ium-3-yl)methyl ester Formula: C10H12ClNO3 MolecularWeight: 229.66018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C[N+](=C1C)[O-])COC(=O)C)Cl

Isomeric SMILES

CC1=C(C(=C[N+](=C1C)[O-])COC(=O)C)Cl

InChI

InChI=1S/C10H12ClNO3/c1-6-7(2)12(14)4-9(10(6)11)5-15-8(3)13/h4H,5H2,1-3H3